![1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione structure](/static/products/879/879462-30-3.png)
1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione
TL;DR: 1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione (CAS 879462-30-3) is a chemical compound with molecular formula C20H19N3O2S and molecular weight 365.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1',6'-dimethyl-1-phenyl-2-sulfanylidenespiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-4,6-dione
Also Known As: 1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione, 1',6'-dimethyl-1-phenyl-2-sulfanyl-1',4'-dihydro-2'H,4H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H)-dione, 1',6'-dimethyl-1-phenyl-2-sulfanylidenespiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-4,6-dione, 1',6'-dimethyl-1-phenyl-2-thioxo-2,2',3,4'-tetrahydro-1H,1'H-spiro[pyrimidine-5,3'-quinoline]-4,6-dione
| Molecular Formula | C20H19N3O2S |
|---|---|
| Molecular Weight | 365.12 g/mol |
| LogP | 2.42162 |
| Topological Polar Surface Area | 52.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 365.1198 |
| Heavy Atoms | 26 |
| Complexity | 927.90845 |
Chemical Identifiers
| CAS Number | 879462-30-3 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(CC3(C2)C(=O)NC(=S)N(C3=O)C4=CC=CC=C4)C |
Product Overview
1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione (CAS 879462-30-3), with molecular formula C20H19N3O2S and molecular weight 365.12 g/mol. IUPAC: 1',6'-dimethyl-1-phenyl-2-sulfanylidenespiro[1,3-diazinane-5,3'-2,4-dihydroquinoline]-4,6-dione.
Chemical Property Profile of 1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione
Property Insights of 1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione
The XLogP value of 2.42162 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione. With a topological polar surface area (TPSA) of 52.65 Ų, 1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione?
The CAS number of 1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione is 879462-30-3.
What is the molecular formula of 1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione?
The molecular formula of 1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione is C20H19N3O2S.
What is the molecular weight of 1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione?
The molecular weight of 1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione is 365.12 g/mol.
Where can I buy 1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione?
You can request a quote for 1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 1',6'-dimethyl-1-phenyl-2-thioxo-1',4'-dihydro-2H,2'H-spiro[pyrimidine-5,3'-quinoline]-4,6(1H,3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.